2,5-Dihydroxynaphthalene-1,6-dicarboxylic acid

Base Information

• Chemical Name: 2,5-Dihydroxynaphthalene-1,6-dicarboxylic acid
• CAS No.: 154030-54-3
• Molecular Formula: C12H8 O6
• Molecular Weight: 248.19
• DSSTox Substance ID: DTXSID90697903
• Mol file: 154030-54-3.mol

Synonyms:2,5-dihydroxynaphthalene-1,6-dicarboxylic acid;154030-54-3;SCHEMBL1174147;1,6-DIHYDROXYNAPHTHALENE-2,5-DICARBOXYLIC ACID;DTXSID90697903;2,5-dihydroxynaphthalene-1,6-dicarboxylicacid

Chemical Property of 2,5-Dihydroxynaphthalene-1,6-dicarboxylic acid

Chemical Property:

• Boiling Point: 540.2±50.0 °C(Predicted)
• PKA: 2.80±0.10(Predicted)
• PSA: 115.06000
• Density: 1.706±0.06 g/cm3(Predicted)
• LogP: 1.64740
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 248.03208797
• Heavy Atom Count: 18
• Complexity: 355

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C2=C1C(=C(C=C2)O)C(=O)O)O)C(=O)O

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